==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=15-JAN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER PROTEIN BINDING, TRANSFERASE 02-AUG-09 3IIM . COMPND 2 MOLECULE: COILIN-INTERACTING NUCLEAR ATPASE PROTEIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.E.ZOGRAPHOS,C.E.DRAKOU,D.D.LEONIDAS . 174 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 10473.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 124 71.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 11.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 5 2.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 10 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 12 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 71 40.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 2.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 0 0 1 0 1 1 0 2 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 -1 A E 0 0 167 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 99.0 -4.2 -48.1 7.3 2 0 A F + 0 0 211 2,-0.1 2,-0.4 0, 0.0 0, 0.0 -0.502 360.0 133.3-121.5 60.7 -6.3 -48.5 10.4 3 1 A M - 0 0 90 -2,-0.2 2,-0.4 170,-0.0 170,-0.1 -0.877 57.5-121.6-110.2 141.7 -7.4 -44.9 11.2 4 2 A L - 0 0 109 -2,-0.4 168,-0.1 168,-0.3 70,-0.1 -0.711 37.4-166.8 -72.4 131.3 -10.9 -43.5 12.0 5 3 A L - 0 0 37 -2,-0.4 70,-0.6 68,-0.3 71,-0.1 -0.951 14.0-119.0-125.3 146.2 -11.6 -40.9 9.4 6 4 A P - 0 0 0 0, 0.0 69,-0.6 0, 0.0 70,-0.4 -0.294 14.7-131.9 -81.3 163.0 -14.4 -38.3 9.3 7 5 A N - 0 0 3 68,-0.2 85,-2.3 67,-0.2 86,-1.0 -0.959 21.9-163.0-110.8 141.1 -17.2 -37.8 6.9 8 6 A I E -ab 77 93A 0 68,-2.5 70,-3.1 -2,-0.4 2,-0.5 -0.961 8.1-152.1-127.4 134.0 -17.9 -34.3 5.5 9 7 A L E -ab 78 94A 0 84,-1.9 86,-3.1 -2,-0.4 2,-0.6 -0.929 5.6-167.2-105.5 129.3 -21.0 -33.0 3.8 10 8 A L E +ab 79 95A 0 68,-3.3 70,-2.0 -2,-0.5 2,-0.2 -0.973 24.8 158.4-110.8 116.1 -20.6 -30.2 1.2 11 9 A T E + b 0 96A 0 84,-2.8 86,-2.6 -2,-0.6 2,-0.2 -0.743 7.1 110.5-131.6 179.1 -24.0 -28.7 0.4 12 10 A G - 0 0 0 68,-0.4 86,-0.1 -2,-0.2 3,-0.1 -0.596 68.9 -40.3 131.5 162.7 -25.5 -25.4 -0.9 13 11 A T S > S- 0 0 2 84,-0.4 3,-1.9 -2,-0.2 5,-0.3 -0.140 74.6 -86.8 -53.2 144.3 -27.3 -24.2 -4.1 14 12 A P T 3 S+ 0 0 14 0, 0.0 -1,-0.1 0, 0.0 94,-0.1 -0.333 116.6 31.7 -51.2 138.7 -26.0 -25.5 -7.5 15 13 A G T 3 S+ 0 0 7 -3,-0.1 -2,-0.1 92,-0.1 92,-0.1 0.206 83.3 109.1 96.3 -13.6 -23.2 -23.3 -8.7 16 14 A V S < S- 0 0 0 -3,-1.9 82,-0.1 81,-0.1 -3,-0.1 0.747 95.9 -94.8 -71.5 -24.8 -21.7 -22.3 -5.3 17 15 A G S > S+ 0 0 18 -4,-0.2 4,-2.5 80,-0.1 5,-0.2 0.575 76.9 136.9 123.1 17.6 -18.5 -24.4 -5.7 18 16 A K H > S+ 0 0 13 -5,-0.3 4,-3.0 2,-0.2 5,-0.2 0.914 77.7 43.9 -60.2 -47.1 -19.2 -27.8 -4.0 19 17 A T H > S+ 0 0 48 2,-0.2 4,-2.6 1,-0.2 5,-0.3 0.929 113.8 50.7 -66.8 -44.6 -17.7 -30.0 -6.7 20 18 A T H > S+ 0 0 85 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.938 116.8 41.0 -56.8 -48.8 -14.6 -27.7 -7.1 21 19 A L H X S+ 0 0 2 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.922 114.5 51.0 -66.9 -46.6 -14.0 -27.8 -3.3 22 20 A G H X S+ 0 0 0 -4,-3.0 4,-2.2 -5,-0.2 -2,-0.2 0.875 110.9 48.0 -61.0 -41.6 -14.8 -31.5 -2.8 23 21 A K H X S+ 0 0 119 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.884 113.4 47.4 -69.0 -37.4 -12.4 -32.6 -5.6 24 22 A E H X S+ 0 0 51 -4,-1.6 4,-1.9 -5,-0.3 -2,-0.2 0.928 111.7 50.6 -70.1 -43.6 -9.6 -30.5 -4.3 25 23 A L H X S+ 0 0 0 -4,-2.9 4,-0.8 2,-0.2 6,-0.4 0.895 110.4 49.8 -56.2 -44.7 -10.2 -31.7 -0.7 26 24 A A H >X S+ 0 0 17 -4,-2.2 4,-2.4 1,-0.2 3,-0.8 0.930 110.7 48.9 -62.1 -47.0 -10.1 -35.3 -1.8 27 25 A S H 3< S+ 0 0 91 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.862 117.2 42.5 -59.7 -36.8 -6.9 -34.9 -3.8 28 26 A K H 3< S+ 0 0 115 -4,-1.9 -1,-0.2 1,-0.1 -2,-0.2 0.446 125.9 29.3 -95.4 -2.4 -5.2 -33.1 -0.8 29 27 A S H << S- 0 0 38 -4,-0.8 -2,-0.2 -3,-0.8 -3,-0.2 0.508 94.7-123.9-127.8 -15.9 -6.5 -35.4 2.0 30 28 A G < + 0 0 59 -4,-2.4 -4,-0.1 1,-0.3 -3,-0.1 0.451 64.9 138.8 76.2 0.7 -6.9 -38.8 0.4 31 29 A L - 0 0 10 -6,-0.4 2,-0.4 -5,-0.2 -1,-0.3 -0.415 61.9-101.9 -71.0 155.5 -10.5 -38.9 1.5 32 30 A K E -c 76 0A 130 43,-2.5 45,-3.4 -3,-0.1 2,-0.5 -0.674 30.8-145.3 -84.6 132.0 -13.0 -40.2 -1.0 33 31 A Y E -c 77 0A 47 -2,-0.4 2,-0.5 43,-0.2 45,-0.2 -0.825 14.7-171.1 -98.5 131.8 -15.1 -37.7 -2.9 34 32 A I E -c 78 0A 19 43,-3.2 45,-2.6 -2,-0.5 2,-0.7 -0.964 12.7-161.4-126.8 116.7 -18.6 -38.6 -3.9 35 33 A N E > -c 79 0A 26 -2,-0.5 4,-2.5 43,-0.2 5,-0.2 -0.858 11.0-156.7 -88.6 112.8 -20.8 -36.4 -6.1 36 34 A V H > S+ 0 0 0 43,-2.5 4,-2.6 -2,-0.7 5,-0.2 0.877 91.0 51.7 -62.6 -40.5 -24.3 -37.6 -5.4 37 35 A G H > S+ 0 0 16 42,-0.4 4,-1.7 2,-0.2 -1,-0.2 0.921 112.9 45.9 -58.5 -45.5 -25.7 -36.4 -8.8 38 36 A D H > S+ 0 0 68 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.888 112.1 50.8 -64.0 -42.7 -23.0 -38.3 -10.6 39 37 A L H X S+ 0 0 31 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.913 109.2 50.8 -62.0 -44.3 -23.5 -41.4 -8.4 40 38 A A H <>S+ 0 0 0 -4,-2.6 5,-2.3 1,-0.2 4,-0.5 0.857 112.9 47.2 -60.8 -37.6 -27.2 -41.4 -9.1 41 39 A R H <5S+ 0 0 145 -4,-1.7 3,-0.3 3,-0.2 -2,-0.2 0.916 114.2 45.7 -67.5 -47.7 -26.5 -41.1 -12.9 42 40 A E H <5S+ 0 0 143 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.895 122.9 34.5 -65.9 -41.9 -23.9 -43.9 -12.8 43 41 A E T <5S- 0 0 87 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.2 0.365 106.9-124.0 -98.9 3.9 -26.0 -46.3 -10.7 44 42 A Q T 5 + 0 0 148 -4,-0.5 2,-1.3 -3,-0.3 -3,-0.2 0.900 44.7 168.9 57.8 50.4 -29.3 -45.1 -12.3 45 43 A L < + 0 0 0 -5,-2.3 14,-2.4 -6,-0.2 2,-0.4 -0.543 26.9 124.7 -96.5 69.6 -30.9 -44.2 -8.9 46 44 A Y E -E 58 0B 75 -2,-1.3 2,-0.3 12,-0.3 12,-0.2 -0.967 35.4-176.4-129.3 145.3 -34.0 -42.4 -10.2 47 45 A D E - 0 0 115 10,-2.9 13,-0.1 -2,-0.4 -2,-0.0 -0.860 58.9 -15.5-143.0 107.8 -37.7 -42.8 -9.7 48 46 A G E - 0 0 47 -2,-0.3 9,-3.2 8,-0.1 2,-0.4 -0.070 69.4 -99.1 89.1 168.1 -40.1 -40.6 -11.6 49 47 A Y E -E 56 0B 128 7,-0.3 2,-0.6 -3,-0.1 -1,-0.0 -0.988 20.6-132.2-130.8 135.1 -39.8 -37.4 -13.5 50 48 A D E >> -E 55 0B 46 5,-3.1 5,-1.2 -2,-0.4 4,-0.9 -0.802 14.6-163.1 -89.5 120.8 -40.5 -33.8 -12.4 51 49 A E T 45S+ 0 0 170 -2,-0.6 -1,-0.2 2,-0.2 0, 0.0 0.892 85.0 43.9 -71.2 -42.9 -42.6 -32.0 -15.0 52 50 A E T 45S+ 0 0 119 1,-0.2 -1,-0.2 2,-0.1 -2,-0.0 0.865 122.5 35.6 -75.1 -39.3 -42.1 -28.4 -13.9 53 51 A Y T 45S- 0 0 112 2,-0.1 -1,-0.2 67,-0.0 -2,-0.2 0.575 101.0-133.6 -88.0 -13.4 -38.3 -28.6 -13.3 54 52 A D T <5 + 0 0 109 -4,-0.9 -3,-0.2 1,-0.2 -2,-0.1 0.983 62.1 114.7 51.5 69.3 -37.7 -31.0 -16.2 55 53 A C E - 0 0 31 -14,-2.4 4,-2.2 1,-0.2 5,-0.2 -0.781 26.0-171.2 -88.3 97.1 -34.4 -41.9 -5.6 60 58 A E H > S+ 0 0 87 -2,-1.1 4,-2.3 1,-0.2 -1,-0.2 0.874 78.2 50.9 -64.6 -41.6 -33.4 -40.8 -2.1 61 59 A D H > S+ 0 0 124 1,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.907 111.7 48.0 -61.0 -45.1 -33.8 -44.2 -0.3 62 60 A R H > S+ 0 0 122 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.872 109.3 53.5 -65.5 -38.6 -31.7 -46.0 -3.0 63 61 A V H X S+ 0 0 0 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.943 111.0 46.6 -57.5 -48.9 -29.0 -43.3 -2.8 64 62 A V H X S+ 0 0 20 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.938 114.1 47.2 -59.0 -49.1 -28.8 -43.8 1.0 65 63 A D H < S+ 0 0 121 -4,-2.7 4,-0.5 1,-0.2 -1,-0.2 0.885 110.4 54.0 -58.9 -41.0 -28.7 -47.7 0.6 66 64 A E H < S+ 0 0 90 -4,-2.7 4,-0.2 1,-0.2 -1,-0.2 0.867 119.8 31.2 -60.8 -38.0 -26.0 -47.3 -2.1 67 65 A L H X S+ 0 0 2 -4,-1.8 4,-2.4 -3,-0.2 3,-0.3 0.623 92.0 93.5 -97.1 -19.1 -23.7 -45.2 0.2 68 66 A D H X S+ 0 0 24 -4,-2.0 4,-2.5 1,-0.2 5,-0.2 0.858 84.5 48.3 -53.8 -50.1 -24.4 -46.5 3.6 69 67 A N H > S+ 0 0 123 -4,-0.5 4,-1.2 1,-0.2 -1,-0.2 0.909 115.3 45.8 -58.3 -44.2 -21.7 -49.2 4.0 70 68 A Q H > S+ 0 0 78 -3,-0.3 4,-0.8 -4,-0.2 -1,-0.2 0.868 111.1 52.3 -65.5 -40.6 -19.0 -46.8 2.7 71 69 A M H >< S+ 0 0 3 -4,-2.4 3,-0.8 1,-0.2 -2,-0.2 0.893 105.6 55.7 -62.7 -39.2 -20.3 -44.0 5.0 72 70 A R H 3< S+ 0 0 159 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.837 104.7 53.4 -62.0 -32.9 -20.1 -46.3 8.0 73 71 A E H 3< S- 0 0 166 -4,-1.2 -68,-0.3 -5,-0.2 -1,-0.3 0.655 107.2-144.1 -79.3 -16.1 -16.4 -47.0 7.2 74 72 A G << + 0 0 19 -3,-0.8 -67,-0.2 -4,-0.8 -1,-0.1 0.096 64.6 96.6 82.7 169.1 -15.7 -43.2 7.2 75 73 A G + 0 0 4 -69,-0.6 -43,-2.5 -70,-0.6 2,-0.4 0.846 56.7 135.5 80.0 39.4 -13.5 -40.9 5.2 76 74 A V E - c 0 32A 1 -70,-0.4 -68,-2.5 -45,-0.2 2,-0.6 -0.959 43.4-155.8-126.6 134.1 -16.0 -39.7 2.6 77 75 A I E -ac 8 33A 0 -45,-3.4 -43,-3.2 -2,-0.4 2,-0.4 -0.957 20.0-161.0-106.2 115.6 -16.7 -36.2 1.3 78 76 A V E -ac 9 34A 0 -70,-3.1 -68,-3.3 -2,-0.6 2,-0.5 -0.858 5.4-164.7-105.0 134.5 -20.3 -36.0 0.0 79 77 A D E +ac 10 35A 5 -45,-2.6 -43,-2.5 -2,-0.4 -42,-0.4 -0.969 27.2 134.0-123.3 113.2 -21.4 -33.3 -2.4 80 78 A Y - 0 0 30 -70,-2.0 -68,-0.4 -2,-0.5 2,-0.3 -0.967 56.0-127.1-156.9 151.8 -25.1 -32.6 -3.0 81 79 A H S S+ 0 0 85 -2,-0.3 2,-0.3 -70,-0.2 -70,-0.1 -0.185 96.9 49.1 -89.5 40.1 -27.6 -29.7 -3.2 82 80 A G + 0 0 6 -2,-0.3 48,-0.0 -69,-0.1 -2,-0.0 -0.924 49.9 168.5-166.6 155.9 -29.8 -31.4 -0.7 83 81 A C > + 0 0 0 -2,-0.3 3,-0.9 -72,-0.0 -1,-0.0 0.460 51.9 95.3-151.7 -7.6 -29.2 -32.9 2.8 84 82 A D T 3 S+ 0 0 94 1,-0.2 4,-0.1 54,-0.0 -2,-0.0 0.741 87.7 51.7 -68.3 -22.4 -32.5 -33.6 4.6 85 83 A F T 3 S+ 0 0 32 2,-0.1 -1,-0.2 3,-0.0 -21,-0.1 0.569 84.8 99.8 -93.0 -11.2 -32.7 -37.2 3.5 86 84 A F S < S- 0 0 10 -3,-0.9 2,-0.1 1,-0.1 5,-0.0 -0.526 88.8 -98.7 -71.2 141.8 -29.2 -38.4 4.6 87 85 A P > - 0 0 28 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.416 28.7-133.2 -56.4 131.1 -28.9 -40.2 7.9 88 86 A E G > S+ 0 0 96 1,-0.3 3,-1.0 2,-0.2 51,-0.1 0.843 102.2 65.3 -56.5 -34.3 -27.8 -37.7 10.5 89 87 A R G 3 S+ 0 0 141 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.657 85.5 75.3 -64.1 -20.8 -25.2 -40.1 11.8 90 88 A W G < S+ 0 0 3 -3,-1.7 2,-0.4 1,-0.1 -1,-0.2 0.865 87.4 63.9 -59.6 -41.7 -23.2 -40.0 8.5 91 89 A F < - 0 0 9 -3,-1.0 -83,-0.2 -4,-0.4 3,-0.1 -0.769 44.4-177.7-107.6 133.2 -21.7 -36.6 8.9 92 90 A H S S+ 0 0 69 -85,-2.3 2,-0.3 -2,-0.4 -84,-0.2 0.697 86.1 10.0 -89.4 -22.3 -19.2 -35.2 11.5 93 91 A I E -b 8 0A 7 -86,-1.0 -84,-1.9 2,-0.0 2,-0.4 -0.981 65.6-154.2-155.6 149.9 -19.3 -31.8 10.0 94 92 A V E -bd 9 143A 0 48,-3.1 50,-2.4 -2,-0.3 2,-0.5 -0.993 6.5-163.9-132.3 123.5 -21.5 -30.0 7.4 95 93 A F E -bd 10 144A 12 -86,-3.1 -84,-2.8 -2,-0.4 2,-0.7 -0.936 4.5-160.8-110.6 130.3 -20.5 -27.0 5.3 96 94 A V E -bd 11 145A 0 48,-2.8 50,-2.4 -2,-0.5 2,-0.3 -0.933 16.6-147.2-106.7 107.1 -23.0 -24.9 3.4 97 95 A L E - d 0 146A 0 -86,-2.6 2,-0.4 -2,-0.7 -84,-0.4 -0.577 15.0-162.7 -77.5 138.8 -21.2 -23.0 0.7 98 96 A R E - d 0 147A 47 48,-2.9 50,-2.4 -2,-0.3 2,-0.4 -0.956 8.7-172.0-126.5 140.8 -22.7 -19.6 -0.0 99 97 A T - 0 0 3 -2,-0.4 50,-0.1 48,-0.2 5,-0.1 -1.000 35.2-102.8-136.3 132.5 -22.2 -17.4 -3.0 100 98 A D > - 0 0 103 -2,-0.4 4,-2.9 1,-0.1 5,-0.2 -0.239 36.3-120.0 -52.4 140.6 -23.3 -13.8 -3.5 101 99 A T H > S+ 0 0 50 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.865 111.4 50.8 -58.2 -41.5 -26.4 -13.8 -5.7 102 100 A N H > S+ 0 0 124 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.931 114.2 44.7 -62.5 -46.4 -24.9 -11.6 -8.5 103 101 A V H > S+ 0 0 51 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.914 113.5 50.3 -62.8 -44.0 -21.8 -13.9 -8.6 104 102 A L H X S+ 0 0 0 -4,-2.9 4,-2.3 1,-0.2 5,-0.2 0.894 106.4 55.0 -65.1 -41.3 -23.9 -17.1 -8.5 105 103 A Y H X S+ 0 0 87 -4,-2.5 4,-2.5 -5,-0.2 -1,-0.2 0.911 106.3 50.8 -57.4 -46.5 -26.2 -15.9 -11.3 106 104 A E H X S+ 0 0 120 -4,-1.6 4,-1.9 1,-0.2 -1,-0.2 0.878 111.1 49.8 -61.6 -37.0 -23.2 -15.3 -13.7 107 105 A R H X S+ 0 0 77 -4,-1.6 4,-1.0 2,-0.2 -1,-0.2 0.921 114.4 42.7 -64.4 -45.7 -22.0 -18.9 -13.0 108 106 A L H <>S+ 0 0 0 -4,-2.3 5,-1.5 2,-0.2 4,-0.3 0.794 110.7 56.0 -76.5 -29.8 -25.3 -20.5 -13.6 109 107 A E H ><5S+ 0 0 103 -4,-2.5 3,-1.9 -5,-0.2 -1,-0.2 0.932 104.7 53.5 -63.2 -46.3 -25.9 -18.4 -16.7 110 108 A T H 3<5S+ 0 0 125 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.774 98.7 64.8 -59.0 -30.1 -22.6 -19.6 -18.1 111 109 A R T 3<5S- 0 0 142 -4,-1.0 -1,-0.3 -5,-0.1 -2,-0.2 0.650 118.2-113.7 -66.4 -17.1 -23.9 -23.2 -17.5 112 110 A G T < 5 + 0 0 65 -3,-1.9 2,-0.2 -4,-0.3 -3,-0.2 0.751 55.3 166.6 85.5 26.7 -26.5 -22.5 -20.1 113 111 A Y < - 0 0 46 -5,-1.5 -1,-0.3 -4,-0.1 2,-0.0 -0.547 32.7-126.9 -67.5 136.2 -29.5 -22.7 -17.7 114 112 A N > - 0 0 108 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.204 34.0 -88.0 -75.4 177.7 -32.7 -21.2 -19.2 115 113 A E H > S+ 0 0 137 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.887 124.1 48.1 -58.0 -47.4 -34.7 -18.5 -17.5 116 114 A K H > S+ 0 0 111 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.878 115.6 44.4 -64.1 -39.3 -36.9 -20.8 -15.3 117 115 A K H > S+ 0 0 95 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.903 113.4 50.9 -73.1 -42.6 -34.0 -22.9 -14.1 118 116 A L H X S+ 0 0 10 -4,-2.8 4,-2.7 2,-0.2 5,-0.2 0.930 112.6 47.5 -53.8 -49.4 -31.9 -19.7 -13.4 119 117 A T H X S+ 0 0 48 -4,-2.8 4,-2.5 -5,-0.2 5,-0.2 0.925 111.8 47.6 -64.4 -47.8 -34.8 -18.2 -11.5 120 118 A D H X S+ 0 0 63 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.924 116.6 44.5 -58.6 -45.8 -35.5 -21.2 -9.3 121 119 A N H X S+ 0 0 15 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.907 112.9 49.9 -67.0 -42.6 -31.8 -21.7 -8.5 122 120 A I H X S+ 0 0 24 -4,-2.7 4,-2.4 -5,-0.2 -2,-0.2 0.888 111.9 48.5 -65.7 -35.7 -31.2 -18.0 -7.8 123 121 A Q H X S+ 0 0 88 -4,-2.5 4,-2.2 2,-0.2 6,-0.2 0.859 104.5 60.3 -70.6 -34.8 -34.2 -17.9 -5.5 124 122 A C H <>S+ 0 0 22 -4,-1.9 5,-2.3 -5,-0.2 6,-0.4 0.910 111.4 40.8 -56.5 -42.4 -33.0 -21.0 -3.7 125 123 A E H ><5S+ 0 0 6 -4,-1.6 3,-1.5 3,-0.2 -2,-0.2 0.927 114.5 49.2 -72.1 -46.0 -29.8 -19.1 -2.8 126 124 A I H 3<5S+ 0 0 97 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.728 112.8 48.7 -72.3 -21.0 -31.5 -15.8 -2.0 127 125 A F T 3<5S- 0 0 121 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.370 107.3-130.1 -91.5 -1.4 -34.0 -17.6 0.3 128 126 A Q T <>5 + 0 0 86 -3,-1.5 4,-2.4 -5,-0.1 5,-0.2 0.846 47.9 161.9 56.2 39.0 -31.1 -19.5 1.9 129 127 A V H >< + 0 0 59 -5,-2.3 4,-2.3 -6,-0.2 5,-0.1 0.898 67.8 43.6 -59.9 -46.3 -32.9 -22.8 1.4 130 128 A L H > S+ 0 0 7 -6,-0.4 4,-2.5 2,-0.2 -1,-0.2 0.863 111.4 54.2 -74.8 -34.3 -30.0 -25.2 1.8 131 129 A Y H > S+ 0 0 75 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.943 112.6 44.0 -59.7 -47.4 -28.6 -23.4 4.8 132 130 A E H X S+ 0 0 124 -4,-2.4 4,-2.0 1,-0.2 -2,-0.2 0.865 112.4 52.8 -66.1 -36.6 -32.0 -23.7 6.5 133 131 A E H X S+ 0 0 42 -4,-2.3 4,-1.2 -5,-0.2 -1,-0.2 0.899 110.6 47.5 -64.3 -41.9 -32.3 -27.3 5.4 134 132 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 3,-0.3 0.917 112.2 48.6 -65.1 -45.1 -28.8 -28.1 6.9 135 133 A T H < S+ 0 0 57 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.870 112.4 49.5 -65.6 -33.5 -29.6 -26.4 10.2 136 134 A A H < S+ 0 0 89 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.756 117.6 40.9 -73.7 -23.6 -33.0 -28.3 10.3 137 135 A S H < S+ 0 0 26 -4,-1.2 2,-0.3 -3,-0.3 -2,-0.2 0.653 117.0 35.9-101.4 -19.6 -31.3 -31.6 9.6 138 136 A Y S < S- 0 0 6 -4,-1.9 5,-0.1 -5,-0.1 -1,-0.1 -0.917 94.1 -78.6-135.1 158.3 -28.0 -31.5 11.7 139 137 A K >> - 0 0 119 -2,-0.3 3,-1.7 1,-0.1 4,-0.5 -0.303 39.1-126.9 -53.6 134.6 -26.8 -30.1 15.1 140 138 A E G >4 S+ 0 0 172 1,-0.3 3,-1.1 2,-0.2 -1,-0.1 0.846 106.4 63.8 -48.9 -42.2 -26.2 -26.3 14.9 141 139 A E G 34 S+ 0 0 143 1,-0.2 -1,-0.3 3,-0.0 -2,-0.1 0.651 105.9 43.1 -63.1 -19.5 -22.6 -26.9 16.3 142 140 A I G <4 S+ 0 0 33 -3,-1.7 -48,-3.1 -49,-0.1 2,-0.5 0.434 94.2 90.7-109.0 -0.2 -21.5 -28.9 13.2 143 141 A V E << +d 94 0A 16 -3,-1.1 2,-0.4 -4,-0.5 -48,-0.2 -0.860 52.0 174.2 -99.0 128.2 -23.1 -26.7 10.5 144 142 A H E -d 95 0A 76 -50,-2.4 -48,-2.8 -2,-0.5 2,-0.4 -0.999 25.6-137.0-136.5 133.8 -20.9 -23.9 9.0 145 143 A Q E -d 96 0A 78 -2,-0.4 -48,-0.2 -50,-0.2 -50,-0.0 -0.722 20.8-160.8 -87.0 140.4 -21.4 -21.5 6.2 146 144 A L E -d 97 0A 22 -50,-2.4 -48,-2.9 -2,-0.4 2,-0.2 -0.985 18.3-124.3-122.6 129.2 -18.5 -21.0 3.9 147 145 A P E +d 98 0A 59 0, 0.0 -48,-0.2 0, 0.0 10,-0.1 -0.472 29.7 177.1 -66.4 137.6 -18.0 -18.0 1.6 148 146 A S + 0 0 9 -50,-2.4 -130,-0.0 -2,-0.2 -51,-0.0 -0.390 41.1 105.1-145.0 61.6 -17.5 -19.2 -2.0 149 147 A N S S+ 0 0 26 1,-0.2 -1,-0.1 -50,-0.1 -50,-0.1 0.715 76.5 33.4-109.7 -34.5 -17.2 -16.2 -4.3 150 148 A K S >> S- 0 0 138 1,-0.1 4,-1.7 -3,-0.1 3,-1.0 -0.893 78.5-112.2-130.8 153.4 -13.5 -15.9 -5.2 151 149 A P H 3> S+ 0 0 110 0, 0.0 4,-2.6 0, 0.0 5,-0.1 0.845 118.3 60.4 -51.3 -38.7 -10.5 -18.2 -5.7 152 150 A E H 3> S+ 0 0 145 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.843 104.6 49.3 -55.7 -38.6 -9.0 -16.8 -2.5 153 151 A E H <> S+ 0 0 54 -3,-1.0 4,-2.6 2,-0.2 -1,-0.2 0.886 108.0 52.0 -72.1 -40.2 -12.0 -18.1 -0.7 154 152 A L H X S+ 0 0 38 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.931 110.8 50.0 -56.5 -45.8 -11.7 -21.5 -2.2 155 153 A E H X S+ 0 0 140 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.908 111.7 46.7 -59.8 -45.3 -8.1 -21.5 -1.1 156 154 A N H X S+ 0 0 84 -4,-2.1 4,-2.7 2,-0.2 -1,-0.2 0.878 112.1 51.2 -64.1 -38.6 -9.1 -20.5 2.5 157 155 A N H X S+ 0 0 2 -4,-2.6 4,-2.5 2,-0.2 5,-0.2 0.920 110.4 48.0 -64.2 -47.5 -11.9 -23.2 2.5 158 156 A V H X S+ 0 0 7 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.946 114.5 47.6 -56.0 -49.8 -9.5 -25.9 1.4 159 157 A D H X S+ 0 0 63 -4,-2.3 4,-2.0 1,-0.2 -2,-0.2 0.927 113.5 45.9 -60.2 -49.0 -7.0 -24.8 4.1 160 158 A Q H X S+ 0 0 98 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.909 115.3 46.0 -64.6 -41.2 -9.5 -24.6 6.9 161 159 A I H X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.922 110.5 52.7 -71.1 -39.7 -11.1 -27.9 6.1 162 160 A L H X S+ 0 0 46 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.895 111.3 48.2 -60.0 -38.9 -7.7 -29.7 5.7 163 161 A K H X S+ 0 0 113 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.882 110.7 50.7 -68.5 -39.0 -6.7 -28.4 9.2 164 162 A W H X S+ 0 0 65 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.907 109.4 51.1 -61.5 -44.6 -10.1 -29.5 10.6 165 163 A I H X S+ 0 0 8 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.920 109.8 50.0 -59.2 -46.3 -9.6 -33.0 9.1 166 164 A E H X S+ 0 0 146 -4,-2.1 4,-2.1 1,-0.2 -1,-0.2 0.932 113.3 45.4 -60.3 -47.5 -6.1 -33.3 10.7 167 165 A Q H X S+ 0 0 96 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.908 112.5 51.0 -62.2 -43.0 -7.4 -32.2 14.1 168 166 A W H X S+ 0 0 27 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.915 109.2 51.0 -62.6 -44.2 -10.4 -34.6 13.9 169 167 A I H < S+ 0 0 36 -4,-2.5 4,-0.3 2,-0.2 3,-0.3 0.929 111.3 47.7 -59.8 -45.5 -8.1 -37.5 13.0 170 168 A K H >< S+ 0 0 151 -4,-2.1 3,-1.2 1,-0.2 -2,-0.2 0.946 112.7 49.0 -59.1 -47.3 -5.8 -36.8 16.0 171 169 A D H 3< S+ 0 0 89 -4,-2.6 3,-0.3 1,-0.3 -1,-0.2 0.724 116.2 42.5 -66.8 -25.2 -8.8 -36.5 18.4 172 170 A H T 3< S+ 0 0 86 -4,-1.6 -1,-0.3 -3,-0.3 -168,-0.3 0.162 110.7 54.4-113.4 15.5 -10.4 -39.7 17.2 173 171 A N < 0 0 45 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.1 -0.422 360.0 360.0-138.7 61.3 -7.3 -41.9 17.0 174 172 A S 0 0 178 -3,-0.3 -3,-0.1 0, 0.0 -4,-0.0 -0.250 360.0 360.0 -64.7 360.0 -5.8 -41.5 20.5